5-benzamido-N-[(4-methylphenyl)methyl]-1-(phenylmethyl)pyrrolo[2,3-b]pyridine-3-carboxamide

Systemtic Name: 5-benzamido-N-[(4-methylphenyl)methyl]-1-(phenylmethyl)pyrrolo[2,3-b]pyridine-3-carboxamide Openeye Name: 5-benzamido-1-benzyl-N-(p-tolylmethyl)pyrrolo[2,3-b]pyridine-3-carboxamide CAS Name: 5-benzamido-N-[(4-methylphenyl)methyl]-1-(phenylmethyl)-3-pyrrolo[2,3-b]pyridinecarboxamide IUPAC Name: 5-benzamido-1-benzyl-N-[(4-methylphenyl)methyl]pyrrolo[2,3-b]pyridine-3-carboxamide Traditional Name: 5-benzamido-1-benzyl-N-(4-methylbenzyl)pyrrolo[2,3-b]pyridine-3-carboxamide Formula: C30H26N4O2 MolecularWeight: 474.55304

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)C2=CN(C3=NC=C(C=C23)NC(=O)C4=CC=CC=C4)CC5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)C2=CN(C3=NC=C(C=C23)NC(=O)C4=CC=CC=C4)CC5=CC=CC=C5

InChI

InChI=1S/C30H26N4O2/c1-21-12-14-22(15-13-21)17-32-30(36)27-20-34(19-23-8-4-2-5-9-23)28-26(27)16-25(18-31-28)33-29(35)24-10-6-3-7-11-24/h2-16,18,20H,17,19H2,1H3,(H,32,36)(H,33,35)